2-[[6-methyl-2-(4-methylphenyl)chromen-4-ylidene]amino]pentanedioic acid

Systemtic Name: 2-[[6-methyl-2-(4-methylphenyl)chromen-4-ylidene]amino]pentanedioic acid Openeye Name: 2-[[6-methyl-2-(p-tolyl)chromen-4-ylidene]amino]pentanedioic acid CAS Name: 2-[[6-methyl-2-(4-methylphenyl)-1-benzopyran-4-ylidene]amino]pentanedioic acid IUPAC Name: 2-[[6-methyl-2-(4-methylphenyl)chromen-4-ylidene]amino]pentanedioic acid Traditional Name: 2-[[6-methyl-2-(p-tolyl)chromen-4-ylidene]amino]glutaric acid Formula: C22H21NO5 MolecularWeight: 379.40584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NC(CCC(=O)O)C(=O)O)C3=C(O2)C=CC(=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NC(CCC(=O)O)C(=O)O)C3=C(O2)C=CC(=C3)C

InChI

InChI=1S/C22H21NO5/c1-13-3-6-15(7-4-13)20-12-18(16-11-14(2)5-9-19(16)28-20)23-17(22(26)27)8-10-21(24)25/h3-7,9,11-12,17H,8,10H2,1-2H3,(H,24,25)(H,26,27)